Information card for entry 1566645

Structure parameters

• Chemical name: ice XI
• Formula: D2 O
• Calculated formula: D2 O
• Title of publication: The equilibrium low-temperature structure of ice
• Authors of publication: Leadbetter, A. J.; Ward, R. C.; Clark, J. W.; Tucker, P. A.; Matsuo, T.; Suga, H.
• Journal of publication: The Journal of Chemical Physics
• Year of publication: 1985
• Journal volume: 82
• Pages of publication: 424
• a: 4.5019 ± 0.0005 Å
• b: 7.7978 ± 0.0008 Å
• c: 7.328 ± 0.0002 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 257.25 ± 0.04 ų
• Number of distinct elements: 2
• Space group number: 36
• Hermann-Mauguin space group symbol: C m c 21
• Hall space group symbol: C 2c -2
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No